| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2010 | 19 | Yes |
Popular Name: (2S)-1-(4-ethylpiperazin-1-yl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one (2S)-1-(4-ethylpiperazin-1-yl)-2…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.36 | 5.98 | -11.62 | 0 | 6 | 0 | 54 | 283.401 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | 8.19 | -47.87 | 1 | 6 | 1 | 55 | 284.409 | 4 | ↓ |
